| SpectraBase Compound ID | GvkgoPBa0Yv |
|---|---|
| InChI | InChI=1S/C33H35N3O5/c1-21-13-15-23(16-14-21)31-32(37)35-25(17-24-18-34-26-9-5-10-27(36-31)30(24)26)20-39-29-12-6-11-28(41-29)33(38)40-19-22-7-3-2-4-8-22/h2-5,7-10,13-16,18,25,28-29,31,34,36H,6,11-12,17,19-20H2,1H3,(H,35,37)/t25-,28?,29?,31?/m0/s1 |
| InChIKey | DTBWZIUQWIPBPL-DMLXCKECSA-N |
| Mol Weight | 553.7 g/mol |
| Molecular Formula | C33H35N3O5 |
| Exact Mass | 553.257671 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2q1RFmhJp9J |
|---|---|
| Name | (-)-N(13)-Desmethyl-C12-desisopropyl-C12-phenylmethylindolactam V 2-benzyloxycarbonyltetrahydropyran-6-yloxy ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H35N3O5 |
| InChI | InChI=1S/C33H35N3O5/c1-21-13-15-23(16-14-21)31-32(37)35-25(17-24-18-34-26-9-5-10-27(36-31)30(24)26)20-39-29-12-6-11-28(41-29)33(38)40-19-22-7-3-2-4-8-22/h2-5,7-10,13-16,18,25,28-29,31,34,36H,6,11-12,17,19-20H2,1H3,(H,35,37)/t25-,28?,29?,31?/m0/s1 |
| InChIKey | DTBWZIUQWIPBPL-DMLXCKECSA-N |
| Molecular Weight | 553.659 g/mol |
| SMILES | N1C(C(N[C@](COC2OC(C(OCc3ccccc3)=O)CCC2)(Cc2c3c1cccc3[nH]c2)[H])=O)c1ccc(cc1)C |
| SPLASH | splash10-0pbf-8922070000-a50dfab8ebe0856993f6 |
| Source of Spectrum | QE-6-3955-25 |
| Wiley ID | 845203 |